Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate
TL;DR: Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate (CAS 5823-10-9) is a chemical compound with molecular formula C14H26NO8PS and molecular weight 399.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-diethoxyphosphoryloxyphenyl)-trimethylazanium;methyl sulfate
Also Known As: Diethyl phosphostigmine methylsulfate, Ro 30340, 3-(Diethylphosphato)-N-trimethylanilinium methylsulfate, 3-(Diethoxyphosphoryloxy)-N-trimethylanilinium methylsulfate, AMMONIUM, (m-HYDROXYPHENYL)TRIMETHYL-, METHYLSULFATE, DIETHYLPHOSPHATE
| Molecular Formula | C14H26NO8PS |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 2.54 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.11166 |
| Heavy Atoms | 25 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 5823-10-9 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-] |
| InChIKey | QFQPCKASCHEWFN-UHFFFAOYSA-M |
Product Overview
Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate (CAS 5823-10-9), with molecular formula C14H26NO8PS and molecular weight 399.11 g/mol. IUPAC: (3-diethoxyphosphoryloxyphenyl)-trimethylazanium;methyl sulfate.
Chemical Property Profile of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate
Property Insights of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate
The XLogP value of 2.54 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate. Following Lipinski's Rule of Five, Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate?
The CAS number of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate is 5823-10-9.
What is the molecular formula of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate?
The molecular formula of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate is C14H26NO8PS.
What is the molecular weight of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate?
The molecular weight of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate is 399.11 g/mol.
Where can I buy Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate?
You can request a quote for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diethylphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.